2,4-Dimethoxybenzaldoxime

HCID 231242CAS 31874-34-7
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(C=NO)c(OC)c1
InChIKey
SFDRVCQSVTYHLU-UHFFFAOYSA-N
Molecular formula
C9H11NO3
Average molar mass
181.19 g/mol
Monoisotopic mass
181.07389321

Names & identifiers

Preferred name
2,4-Dimethoxybenzaldoxime
IUPAC
N-[(2,4-dimethoxyphenyl)methylidene]hydroxylamine

Names & synonyms

2,4-DIMETHOXYBENZALDOXIME31874-34-7DTXSID20282649RefChem:246523DTXCID50233801SFDRVCQSVTYHLU-UXBLZVDNSA-NN-[(2,4-dimethoxyphenyl)methylidene]hydroxylamineMFCD000827832,4-dimethoxy benzaldoximeSCHEMBL2009041SCHEMBL304811092,4-Dimethoxy benzaldehyde oxime
Show more names
SFDRVCQSVTYHLU-UHFFFAOYSA-NAVA02337AKOS030228041FD67084D4851F875849(NE)-N-[(2,4-dimethoxyphenyl)methylidene]hydroxylamine

Database identifiers

CAS
31874-34-7
PubChem CID
231242
DTXSID
DTXSID20282649
EC Number
681-814-9

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
51.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
13

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 33 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Related reactions

3 records
New reaction record

Linked notes

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